SCHEMBL19974800

SCHEMBL19974800

CC(NC(=O)c1ccccc1Br)C(=O)C(=O)NCC1CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 3/20 0.46
HTT P42858 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 2/20 0.41
HPGD P15428 1/20 0.41
P2RX7 Q99572 1/20 0.41
CAPN1 P07384 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19974990 0.86 MAPK14 (0.43) CYP1A2CYP2C19MAPTHPGDP2RX7
SCHEMBL19975398 0.86 MAPK14 (0.43) CYP1A2CYP2C19MAPTHPGDP2RX7
SCHEMBL19974989 0.86 MAPK14 (0.43) CYP1A2CYP2C19MAPTHPGDP2RX7
SCHEMBL19974684 0.85 POLB (0.46) SMN1; SMN2ALDH1A1HTTLMNAMAPT
SCHEMBL19974873 0.85 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1HTTLMNAHPGD
SCHEMBL19975132 0.83 HPGD (0.50) SMN1; SMN2ALDH1A1LMNAMAPTHPGD
SCHEMBL21176278 0.82 PREP (0.47) SMN1; SMN2ALDH1A1CYP3A4HPGDKDM4E
SCHEMBL21183528 0.80 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1HTTCYP1A2CYP3A4
SCHEMBL19975210 0.78 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1LMNAMEN1KMT2A
SCHEMBL19975138 0.78 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1LMNAHPGDMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220356148-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2022-11-10 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
EP-3512836-A1 ANTIVIRAL COMPOUNDS Haplogen GmbH (AT) 2019-07-24 EP disclosed
WO-2018050631-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2018-03-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190225575-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G12A, PLA2G4C SMN1; SMN2 706/4885ALDH1A1 2271/4885HTT 3380/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C SMN1; SMN2 1086/4885ALDH1A1 2673/4885HTT 3569/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C SMN1; SMN2 706/4885ALDH1A1 2271/4885HTT 3380/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.